(2-ethylsulfanyl-3,3-dimethyl-2H-1-benzofuran-5-yl)methylsulfamic acid

Systemtic Name: (2-ethylsulfanyl-3,3-dimethyl-2H-1-benzofuran-5-yl)methylsulfamic acid Openeye Name: (2-ethylsulfanyl-3,3-dimethyl-2H-benzofuran-5-yl)methylsulfamic acid CAS Name: [2-(ethylthio)-3,3-dimethyl-2H-benzofuran-5-yl]methylsulfamic acid IUPAC Name: (2-ethylsulfanyl-3,3-dimethyl-2H-1-benzofuran-5-yl)methylsulfamic acid Traditional Name: [2-(ethylthio)-3,3-dimethyl-coumaran-5-yl]methylsulfamic acid Formula: C13H19NO4S2 MolecularWeight: 317.42426

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1C(C2=C(O1)C=CC(=C2)CNS(=O)(=O)O)(C)C

Isomeric SMILES

CCSC1C(C2=C(O1)C=CC(=C2)CNS(=O)(=O)O)(C)C

InChI

InChI=1S/C13H19NO4S2/c1-4-19-12-13(2,3)10-7-9(5-6-11(10)18-12)8-14-20(15,16)17/h5-7,12,14H,4,8H2,1-3H3,(H,15,16,17)